| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:43 UTC |
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| Update Date | 2025-03-25 01:01:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02246497 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C26H33N3O6 |
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| Molecular Mass | 483.2369 |
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| SMILES | CCC1=C(C)C(=O)NC1Cc1[nH]c(Cc2[nH]cc(CCC(=O)O)c2C(C)=O)c(CCC(=O)O)c1C |
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| InChI Key | IIODMOFKKQVBKY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl alkyl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolespyrrolinessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | lactamcarboxylic acidaryl alkyl ketonearomatic heteromonocyclic compoundcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundvinylogous amideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amidepyrrolinepyrroledicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compound |
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